General Information of the Compound
| Compound ID |
CP0517320
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| Compound Name |
6-[2-chloro-4-(3-methyl-2-oxopyridin-1-yl)phenyl]-N-[(1-methylpiperidin-4-yl)methyl]-1H-indazole-3-carboxamide
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| Formula |
C27H28ClN5O2
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| Molecular Weight |
490.007
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| Canonical SMILES |
CN1CCC(CNC(=O)c2n[nH]c3cc(ccc23)-c2ccc(cc2Cl)-n2cccc(C)c2=O)CC1
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| InChI |
InChI=1S/C27H28ClN5O2/c1-17-4-3-11-33(27(17)35)20-6-8-21(23(28)15-20)19-5-7-22-24(14-19)30-31-25(22)26(34)29-16-18-9-12-32(2)13-10-18/h3-8,11,14-15,18H,9-10,12-13,16H2,1-2H3,(H,29,34)(H,30,31)
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| InChIKey |
WEIYNZIBZDZOPA-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound